SCHEMBL4271671

SCHEMBL4271671

CC(=O)Sc1ccc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc(cc5nc(c(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6ccc2[nH]6)C=C5)[nH]4)C=C3)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.46
▸ STAT1 P42224 1/20 0.46
▸ TOP1 P11387 4/20 0.41
▸ CYCS P99999 4/20 0.40
▸ ABCG2 Q9UNQ0 1/20 0.38
▸ ENPP2 Q13822 1/20 0.37
▸ TERT O14746 4/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4260943 0.99 STAT3 (0.45) STAT3STAT1TOP1CYCSABCG2
SCHEMBL4260277 0.86 STAT3 (0.56) STAT3STAT1TOP1CYCSABCG2
SCHEMBL28476967 0.85 STAT3 (0.46) STAT3STAT1TOP1CYCSABCG2
SCHEMBL4261963 0.85 STAT3 (0.55) STAT3STAT1TOP1CYCSABCG2
SCHEMBL12987775 0.84 STAT3 (0.59) STAT3STAT1TOP1CYCSABCG2
SCHEMBL28466363 0.83 STAT3 (0.52) STAT3STAT1TOP1CYCSABCG2
SCHEMBL30527240 0.83 STAT3 (0.67) STAT3STAT1TOP1CYCSABCG2
SCHEMBL31127548 0.82 STAT3 (0.58) STAT3STAT1TOP1CYCSABCG2
SCHEMBL31127544 0.82 STAT3 (0.58) STAT3STAT1TOP1CYCSABCG2
SCHEMBL227423 0.82 STAT3 (0.54) STAT3STAT1TOP1CYCSABCG2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7518905-B2 High density memory device THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-04-14 — — US disclosed
US-20060209587-A1 High density memory device THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2006-09-21 — — US disclosed
US-7042755-B1 High density non-volatile memory device THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2006-05-09 — — US disclosed
US-6324091-B1 Tightly coupled porphyrin macrocycles for molecular memory storage THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-11-27 — — US disclosed
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